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CHEBI:222670 - Elsamicin B

ChEBI IDCHEBI:222670
ChEBI NameElsamicin B
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FormulaC26H22O10
Net Charge0
Average Mass494.452
Monoisotopic Mass494.12130
SMILESCc1ccc2oc(=O)c3c(O)c4cccc(OC5O[C@H](C)[C@H](O)[C@](C)(O)[C@H]5O)c4c4oc(=O)c1c2c34
InChIInChI=1S/C26H22O10/c1-9-7-8-13-16-14(9)23(30)36-20-15-11(19(27)18(17(16)20)24(31)34-13)5-4-6-12(15)35-25-22(29)26(3,32)21(28)10(2)33-25/h4-8,10,21-22,25,27-29,32H,1-3H3/t10-,21+,22+,25?,26+/m1/s1
InChIKeyHPVDVZANUAGIRR-CFSKDKRZSA-N
ChEBI Ontology
Outgoing Relation(s)
Elsamicin B (CHEBI:222670) is a benzochromenone (CHEBI:64986)
Elsamicin B (CHEBI:222670) is a glycoside (CHEBI:24400)
IUPAC Name 
8-hydroxy-15-methyl-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-4,6-dimethyloxan-2-yl]oxy-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,8,12(20),13,15-octaene-10,17-dione
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4589167ChemSpider